[2-[2-(4-chlorophenyl)ethylamino]-2-oxidanylidene-ethyl] 2-bromanyl-5-methoxy-benzoate

Systemtic Name: [2-[2-(4-chlorophenyl)ethylamino]-2-oxidanylidene-ethyl] 2-bromanyl-5-methoxy-benzoate Openeye Name: [2-[2-(4-chlorophenyl)ethylamino]-2-oxo-ethyl] 2-bromo-5-methoxy-benzoate CAS Name: 2-bromo-5-methoxybenzoic acid [2-[2-(4-chlorophenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-chlorophenyl)ethylamino]-2-oxoethyl] 2-bromo-5-methoxybenzoate Traditional Name: 2-bromo-5-methoxy-benzoic acid [2-[2-(4-chlorophenyl)ethylamino]-2-keto-ethyl] ester Formula: C18H17BrClNO4 MolecularWeight: 426.68888

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)C(=O)OCC(=O)NCCC2=CC=C(C=C2)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)Br)C(=O)OCC(=O)NCCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H17BrClNO4/c1-24-14-6-7-16(19)15(10-14)18(23)25-11-17(22)21-9-8-12-2-4-13(20)5-3-12/h2-7,10H,8-9,11H2,1H3,(H,21,22)